A3138812
3,4-Dimethylphenol , 98% , 95-65-8
Synonym(s):
1,2-Dimethyl-4-hydroxybenzene;3,4-Dimethylphenol;3,4-DMP, asym.-o-Xylenol;3,4-Xylenol;4-Hydroxy-o-xylene
CAS NO.：95-65-8
Empirical Formula: C8H10O
Molecular Weight: 122.16
MDL number: MFCD00002304
EINECS: 202-439-5
Update time: 2022-07-08
PRODUCT Properties
| Melting point: | 65-68 °C |
| Boiling point: | 227 °C(lit.) |
| Density | 1,138 g/cm3 |
| vapor pressure | 0.475-130Pa at 25-66.2℃ |
| refractive index | 1.5442 |
| FEMA | 3596 | 3,4-XYLENOL |
| Flash point: | 61 °C |
| storage temp. | Store below +30°C. |
| solubility | Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| pka | pK1:10.32 (25°C) |
| form | Crystalline Powder |
| color | Off-white to pale cream |
| Odor | DIMETHYLPHENOL slightly smoky and earthy character provides nice roasted notes to seafood, mushroom and coffee flavors.flat dry |
| Odor Type | dry |
| biological source | synthetic |
| explosive limit | 1.4%(V) |
| Water Solubility | SLIGHTLY SOLUBLE |
| Merck | 14,10082 |
| JECFA Number | 708 |
| BRN | 1099267 |
| Exposure limits | ACGIH: TWA 1 ppm |
| InChI | 1S/C8H10O/c1-6-3-4-8(9)5-7(6)2/h3-5,9H,1-2H3 |
| InChIKey | YCOXTKKNXUZSKD-UHFFFAOYSA-N |
| SMILES | Cc1ccc(O)cc1C |
| LogP | 2.23 at 25℃ |
| CAS DataBase Reference | 95-65-8(CAS DataBase Reference) |
| NIST Chemistry Reference | Phenol, 3,4-dimethyl-(95-65-8) |
| EPA Substance Registry System | 3,4-Dimethylphenol (95-65-8) |
Description and Uses
Applications of 3,4-dimethylphenol:
- It can react with ethyl cinnamates in trifluoroacetic acid to form the corresponding dihydrocoumarin derivatives.
- Bromination of 3,4-dimethylphenol using bromine can lead to 6-bromo-3,4-dimethylphenol.
- It can react with 1-fluoro-4-chloromethyl-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoro-borate) (Selectfluor? F-TEDA-BF4) to form 4-fluoro-3,4-dimethylcyclohexa-2,5-dienone.
Safety
| Symbol(GHS) |    GHS05,GHS06,GHS09 |
| Signal word | Danger |
| Hazard statements | H301+H311-H314-H411 |
| Precautionary statements | P260-P273-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338 |
| PPE | Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges |
| Hazard Codes | T,N |
| Risk Statements | 24/25-34-51/53 |
| Safety Statements | 26-36/37/39-45-61 |
| RIDADR | UN 2261 6.1/PG 2 |
| WGK Germany | 3 |
| RTECS | ZE6300000 |
| TSCA | TSCA listed |
| HazardClass | 6.1 |
| PackingGroup | II |
| HS Code | 29071400 |
| Storage Class | 6.1A - Combustible acute toxic Cat. 1 and 2 very toxic hazardous materials |
| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Oral Aquatic Chronic 2 Eye Dam. 1 Skin Corr. 1B |
| Hazardous Substances Data | 95-65-8(Hazardous Substances Data) |
| Limited Quantities | 100ml (liquid) or 0.5 Kg (solid) |
| Excepted Quantities | Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml) |
